N-phenyl-4-[2-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]carbonyl-piperazine-1-carboxamide

Systemtic Name: N-phenyl-4-[2-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]carbonyl-piperazine-1-carboxamide Openeye Name: N-phenyl-4-[2-(thiazol-4-ylmethylsulfanyl)benzoyl]piperazine-1-carboxamide CAS Name: 4-[oxo-[2-(4-thiazolylmethylthio)phenyl]methyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: N-phenyl-4-[2-(1,3-thiazol-4-ylmethylsulfanyl)benzoyl]piperazine-1-carboxamide Traditional Name: N-phenyl-4-[2-(thiazol-4-ylmethylthio)benzoyl]piperazine-1-carboxamide Formula: C22H22N4O2S2 MolecularWeight: 438.56568

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC=C2SCC3=CSC=N3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC=C2SCC3=CSC=N3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H22N4O2S2/c27-21(19-8-4-5-9-20(19)30-15-18-14-29-16-23-18)25-10-12-26(13-11-25)22(28)24-17-6-2-1-3-7-17/h1-9,14,16H,10-13,15H2,(H,24,28)